phenethyl 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)propanoyl]piperazin-2-yl]ethanoate

Systemtic Name: phenethyl 2-[3-oxidanylidene-1-[2-(4-phenylphenoxy)propanoyl]piperazin-2-yl]ethanoate Openeye Name: phenethyl 2-[3-oxo-1-[2-(4-phenylphenoxy)propanoyl]piperazin-2-yl]acetate CAS Name: 2-[3-oxo-1-[1-oxo-2-(4-phenylphenoxy)propyl]-2-piperazinyl]acetic acid phenethyl ester IUPAC Name: phenethyl 2-[3-oxo-1-[2-(4-phenylphenoxy)propanoyl]piperazin-2-yl]acetate Traditional Name: 2-[3-keto-1-[2-(4-phenylphenoxy)propanoyl]piperazin-2-yl]acetic acid phenethyl ester Formula: C29H30N2O5 MolecularWeight: 486.5589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2)OC3=CC=C(C=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C(=O)N1CCNC(=O)C1CC(=O)OCCC2=CC=CC=C2)OC3=CC=C(C=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H30N2O5/c1-21(36-25-14-12-24(13-15-25)23-10-6-3-7-11-23)29(34)31-18-17-30-28(33)26(31)20-27(32)35-19-16-22-8-4-2-5-9-22/h2-15,21,26H,16-20H2,1H3,(H,30,33)